(-)-trans-3-(2-Phenylethyl)-2,3,4,4aalpha,5,6,7,7aalpha-octahydro-1Hbenzo[4,5]furo[3,2-e]isoquinolin-9-ol
SMILES | C1CC2CN(CCC23C(C1)OC4=C3C=CC=C4O)CCC5=CC=CC=C5 |
InChIKey | ZGRGUZOYNFJORG-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 349.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
κ | OPRK | Human | Opioid | A | pKi | 5.91 | 6.87 | 7.82 | PDSP Ki database |
μ | OPRM | Human | Opioid | A | pKi | 6.56 | 8.04 | 9.52 | PDSP Ki database |
δ | OPRD | Human | Opioid | A | pKi | 5.3 | 6.76 | 8.22 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |